Cyclopropylamine - ≥98% , CAS No.765-30-0

CAS: 765-30-0 Cat. No.: C108049 분자식: C₃H₇N 분자량: 57.09 Beilstein Registry Number: 741858 EC 번호: 212-142-2

등급 & 순도 ≥98%

Storage

Room temperature,Argon charged,Desiccated

Shipped In

Normal

개요

Cyclopropylamine(CPA) has been used in the synthesis of N-[4-(4-fluoro)phenyl-2-aminothiazol-5-yl]pyrimidin-2-yl-alkylamine derivatives. It has been used in the synthesis of Pt(CPA)2(bismethylthiomethylenepropanedioate) and Pt(CPA)2(bisethylthiomethylenepropanedioate) complexes

사양

사양 및 순도

≥98%

생화학 및 생리적 메커니즘

Cyclopropylamine inactivates cytochrome P450 enzymes by a mechanism involving initial one-electron oxidation at nitrogen followed by scission of the cyclopropane ring leading to covalent modification of the enzyme. It is a mechanism-based inhibitor of qui

보관 조건

Room temperature,Argon charged,Desiccated

배송

Normal

순수함

≥98%

이름과 식별자

Pubchem Sid

504754448

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504754448

정식 스마일

C1CC1N

IUPAC Name

cyclopropanamine

InChIKey

HTJDQJBWANPRPF-UHFFFAOYSA-N

INCHI

1S/C3H7N/c4-3-1-2-3/h3H,1-2,4H2

이성체 SMILES

C1CC1N

WGK 독일

2

RTECS

GZ0685500

UN 번호

2733

분자량

57.09

Beilstein

741858

Reaxy-Rn

741858

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=741858&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic nitrogen compounds
    • 분류 Organonitrogen compounds
      • Subclass Amines
        • Level5 Primary amines
          • Level6 Monoalkylamines

• Kingdom: Organic compounds
• Superclass: Organic nitrogen compounds
• 분류: Organonitrogen compounds
• Subclass: Amines
• Intermediate Tree Nodes: Primary amines
• Direct Parent: Monoalkylamines
• Alternative Parents: Organopnictogen compounds Hydrocarbon derivatives
• Molecular Framework: Aliphatic homomonocyclic compounds
• Substituents: Organopnictogen compound - Hydrocarbon derivative - Primary aliphatic amine - Aliphatic homomonocyclic compound
• 설명: This compound belongs to the class of organic compounds known as monoalkylamines. These are organic compounds containing an primary aliphatic amine group.
• External Descriptors: a small molecule

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

화학 및 물리적 특성

• 용해성: Miscible with water, ethanol,ether and chloroform.
• 감도: air sensitive;Hygroscopic
• 굴절률: 1.42
• 발화점(°F): 33.8 °F
• 발화점(°C): -26 °C
• 끓는점(°C): 49-50°C
• 녹는점(°C): -10 °C
• 분자량: 57.090 g/mol
• XLogP3: 0.100
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 57.0578 Da
• Monoisotopic Mass: 57.0578 Da
• Topological Polar Surface Area: 26.000 Ų
• Heavy Atom Count: 4
• Formal Charge: 0
• Complexity: 22.500
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1